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88819-55-0 | Acetamide, 2-(1H-benzimidazol-2-ylthio)-N-(2-hydroxyethyl)-
CAS No: 88819-55-0 Catalog No: AG008ATJ MDL No:
Product Description
Catalog Number:
AG008ATJ
Chemical Name:
Acetamide, 2-(1H-benzimidazol-2-ylthio)-N-(2-hydroxyethyl)-
CAS Number:
88819-55-0
Molecular Formula:
C11H13N3O2S
Molecular Weight:
251.3048
IUPAC Name:
2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-hydroxyethyl)acetamide
InChI:
InChI=1S/C11H13N3O2S/c15-6-5-12-10(16)7-17-11-13-8-3-1-2-4-9(8)14-11/h1-4,15H,5-7H2,(H,12,16)(H,13,14)
InChI Key:
FFSHSAVQEZMZGY-UHFFFAOYSA-N
SMILES:
OCCNC(=O)CSc1nc2c([nH]1)cccc2
NSC Number:
601366
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.073g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
251.304g/mol
Monoisotopic Mass:
251.073g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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